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15,16-Dibromo-6,7-dicarbomethoxyoctacyclo[10.10.1,1(4,9).0(3,10).0(2,11).0(15,20).0(13,22)]tetracosa-6,13,15,17,19,21-hexene

View entire compound with spectra: 1 MS (GC)

15,16-Dibromo-6,7-dicarbomethoxyoctacyclo[10.10.1,1(4,9).0(3,10).0(2,11).0(15,20).0(13,22)]tetracosa-6,13,15,17,19,21-hexene
SpectraBase Compound ID GG5VKe3hZUP
InChI InChI=1S/C28H24Br2O4/c1-33-27(31)25-23-15-8-16(24(23)26(25)28(32)34-2)22-20-14-7-13(19(20)21(15)22)11-3-9-5-17(29)18(30)6-10(9)4-12(11)14/h3-6,13-16,19-24H,7-8H2,1-2H3/t13-,14+,15+,16-,19-,20?,21?,22-,23?,24?/m0/s1
InChIKey SSNVPMMHAPWTSO-MYCIDLDESA-N
Mol Weight 584.3 g/mol
Molecular Formula C28H24Br2O4
Exact Mass 582.004135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4P8L1vMGhSj
Name 15,16-Dibromo-6,7-dicarbomethoxyoctacyclo[10.10.1,1(4,9).0(3,10).0(2,11).0(15,20).0(13,22)]tetracosa-6,13,15,17,19,21-hexene
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Formula C28H24Br2O4
InChI InChI=1S/C28H24Br2O4/c1-33-27(31)25-23-15-8-16(24(23)26(25)28(32)34-2)22-20-14-7-13(19(20)21(15)22)11-3-9-5-17(29)18(30)6-10(9)4-12(11)14/h3-6,13-16,19-24H,7-8H2,1-2H3/t13-,14+,15+,16-,19-,20?,21?,22-,23?,24?/m0/s1
InChIKey SSNVPMMHAPWTSO-MYCIDLDESA-N
Molecular Weight 584.304 g/mol
SMILES C1(=C(C(=O)OC)C2C1[C@@]1([C@]3(C4[C@]5(c6cc7cc(Br)c(cc7cc6[C@@]([C@@]4(C3[C@]2(C1)[H])[H])(C5)[H])Br)[H])[H])[H])C(=O)OC
SPLASH splash10-001r-0001090000-42b39f01592e59f8802b
Source of Spectrum KC-61-6972-5
Wiley ID 1629869